2-Propyl-2,3-dihydrobenzo[b][1,4]thiazepin-4(5H)-one CAS 96680-79-4

Purity 97%+In StockPharmaceutical Standards
CAS No.96680-79-4
Molecular FormulaC12H15NOS
Molecular Weight221.32 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

2-Propyl-2,3-dihydrobenzo[b][1,4]thiazepin-4(5H)-one CAS 96680-79-4 chemical structure

Description

Owing to a nitrogen-containing heterocyclic scaffold, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage, 2-Propyl-2,3-dihydrobenzo[b][1,4]thiazepin-4(5H)-one is typically off-white to pale yellow low-melting solid. Its solid-state physicochemical attributes — including a molecular weight of 221.32 g/mol — guide the selection of appropriate sample preparation and analytical techniques. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.

CATO supplies 2-Propyl-2,3-dihydrobenzo[b][1,4]thiazepin-4(5H)-one (CAS 96680-79-4), a certified reference material (molecular formula C12H15NOS, MW 221.32 g/mol) for analytical method development and quality control.

This reference standard is suitable for quantitative analysis on major chromatographic platforms including HPLC, GC, LC-MS/MS, and GC-MS, serving as an external calibration standard or a system suitability test reference material.

As a certified reference material (CRM), 2-Propyl-2,3-dihydrobenzo[b][1,4]thiazepin-4(5H)-one meets the metrological traceability requirements of ISO/IEC 17025 laboratories. Batch-to-batch consistency is monitored via control charts to guarantee comparable assigned values across lots.

Physical & Chemical Properties

Molecular FormulaC12H15NOS
Molecular Weight221.32 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light
Solubility (reference)Soluble in chloroform, dichloromethane, ethyl acetate, DMSO
StabilityLight-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)6.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1984
Nitrogen Atoms1
Sulfur Atoms1

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